#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e0g n LEU 2 N 0.00 -0.85 -4.80 1.04 4.32 -1.26 -4.85 117.00 110.61 2e0g n LEU 2 Ca 0.00 1.95 -0.32 0.00 -0.02 0.00 0.00 56.01 57.62 2e0g n LEU 2 Cb 0.00 -4.15 0.03 0.00 -1.62 0.00 0.00 43.42 37.68 2e0g n LEU 2 CO 0.00 -2.70 0.72 -0.44 -1.22 0.00 0.00 177.39 173.75 2e0g s SER 3 N -7.10 5.50 0.11 -1.43 0.01 -1.26 -4.87 113.70 104.66 2e0g s SER 3 Ca 0.00 1.83 -0.27 0.00 1.31 0.00 0.00 55.95 58.81 2e0g s SER 3 Cb 0.00 -2.53 -0.08 0.00 0.21 0.00 0.00 66.02 63.62 2e0g s SER 3 CO 0.00 -1.36 1.63 0.25 0.41 0.00 0.00 173.24 174.18 2e0g h LEU 4 N 0.09 -0.79 -0.05 2.44 7.12 -1.99 -0.94 115.31 121.20 2e0g h LEU 4 Ca -0.46 0.09 0.01 0.00 0.13 0.00 0.00 57.88 57.65 2e0g h LEU 4 Cb 1.22 0.30 -0.03 0.00 -0.53 0.00 0.00 40.66 41.63 2e0g h LEU 4 CO 0.56 -0.37 -0.22 -0.25 -0.13 0.00 0.00 178.44 178.04 2e0g h TRP 5 N -0.49 -0.64 -0.70 1.25 7.01 -1.97 0.27 115.95 120.69 2e0g h TRP 5 Ca 0.03 0.02 0.14 0.00 2.11 0.00 0.00 58.89 61.19 2e0g h TRP 5 Cb 0.52 0.29 -0.13 0.00 -2.10 0.00 0.00 29.16 27.73 2e0g h TRP 5 CO -0.25 -0.22 -0.21 1.96 -2.79 0.00 0.00 178.44 176.93 2e0g h GLN 6 N -0.23 -0.03 -0.51 2.65 1.08 -1.94 0.14 115.11 116.26 2e0g h GLN 6 Ca 0.01 0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.28 2e0g h GLN 6 Cb 0.27 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.65 2e0g h GLN 6 CO -0.17 -0.02 0.22 0.37 -0.95 0.00 0.00 178.83 178.27 2e0g h GLN 7 N -0.03 0.41 -0.90 1.46 -0.00 -0.52 -1.33 115.11 114.19 2e0g h GLN 7 Ca 0.32 -0.02 0.05 0.00 -0.00 0.00 0.00 58.65 59.00 2e0g h GLN 7 Cb 0.53 -0.09 -0.05 0.00 0.00 0.00 0.00 27.48 27.86 2e0g h GLN 7 CO -0.73 0.27 0.59 0.00 0.00 0.00 0.00 178.83 178.96 2e0g h LEU 9 N 1.08 -0.62 -0.66 0.00 3.38 -0.11 -1.13 115.31 117.25 2e0g h LEU 9 Ca 0.37 -0.05 0.14 0.00 0.09 0.00 0.00 57.88 58.43 2e0g h LEU 9 Cb 0.10 0.16 -0.10 0.00 0.09 0.00 0.00 40.66 40.90 2e0g h LEU 9 CO -0.12 -0.29 0.08 0.00 0.09 0.00 0.00 178.44 178.20 2e0g h ALA 10 N -0.67 0.74 -0.09 1.53 0.00 -1.11 0.29 119.26 119.96 2e0g h ALA 10 Ca -0.07 0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2e0g h ALA 10 Cb 0.63 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2e0g h ALA 10 CO 0.12 -0.36 -0.20 -0.09 0.00 0.00 0.00 179.25 178.72 2e0g h ARG 11 N 0.19 0.15 0.21 0.00 1.12 -1.30 0.46 114.38 115.21 2e0g h ARG 11 Ca 0.36 -0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 59.18 2e0g h ARG 11 Cb 0.58 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.53 2e0g h ARG 11 CO -0.51 0.35 -0.10 1.25 -3.11 0.00 0.00 179.97 177.85 2e0g h LEU 12 N 0.14 -0.23 -1.83 3.80 5.85 0.77 0.44 115.31 124.25 2e0g h LEU 12 Ca 0.03 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2e0g h LEU 12 Cb 0.44 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2e0g h LEU 12 CO 0.03 0.27 0.00 -0.61 -0.34 0.00 0.00 178.44 177.79 2e0g h GLN 13 N -0.84 0.00 0.03 1.25 5.75 -0.75 -2.73 115.11 117.81 2e0g h GLN 13 Ca -0.03 0.00 -0.24 0.00 -0.15 0.00 0.00 58.65 58.24 2e0g h GLN 13 Cb 0.51 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 2e0g h GLN 13 CO 0.05 0.00 -1.27 -0.44 -2.65 0.00 0.00 178.83 174.51 2e0g h ASP 14 N 0.00 0.10 -0.75 -0.69 3.32 -0.88 -3.37 116.42 114.15 2e0g h ASP 14 Ca 0.00 -0.64 0.15 0.00 0.02 0.00 0.00 57.03 56.55 2e0g h ASP 14 Cb 0.37 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.84 2e0g h ASP 14 CO 0.00 1.52 0.50 -0.08 -1.72 0.00 0.00 179.24 179.46 2e0g h GLU 15 N -0.78 0.41 -3.18 3.56 4.81 -0.03 -3.44 114.58 115.94 2e0g h GLU 15 Ca -0.33 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 58.83 2e0g h GLU 15 Cb 1.43 -0.09 -0.14 0.00 0.63 0.00 0.00 28.75 30.58 2e0g h GLU 15 CO -0.13 0.27 0.00 -0.51 -0.73 0.00 0.00 179.01 177.92 2e0g s LEU 16 N -9.38 0.11 0.00 1.64 1.43 -1.04 -5.02 118.68 106.42 2e0g s LEU 16 Ca -0.08 -0.14 0.15 0.00 -1.03 0.00 0.00 54.13 53.02 2e0g s LEU 16 Cb 0.21 2.04 0.71 0.00 0.03 0.00 0.00 46.19 49.18 2e0g s LEU 16 CO 0.77 -0.84 1.42 -0.81 0.23 0.00 0.00 176.35 177.11 2e0g n PRO 17 N -0.10 0.16 -1.54 1.29 -0.04 -1.26 -4.25 135.00 129.26 2e0g n PRO 17 Ca -0.17 0.17 -0.28 0.00 -0.04 0.00 0.00 63.50 63.18 2e0g n PRO 17 Cb 0.63 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.50 2e0g n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2e0g n ALA 18 N -1.34 0.61 1.02 0.55 0.00 -1.26 -4.71 120.51 115.38 2e0g n ALA 18 Ca 0.06 -0.93 0.13 0.00 0.00 0.00 0.00 53.44 52.69 2e0g n ALA 18 Cb 0.13 -2.95 0.36 0.00 0.00 0.00 0.00 19.45 16.99 2e0g n ALA 18 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2e0g n THR 19 N 7.79 0.00 -0.28 0.00 -1.04 -1.26 -4.20 114.28 115.29 2e0g n THR 19 Ca 0.50 -0.01 0.01 0.00 -2.04 0.00 0.00 64.05 62.51 2e0g n THR 19 Cb 0.36 0.05 0.08 0.00 -1.82 0.00 0.00 70.33 69.01 2e0g n THR 19 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2e0g h GLU 20 N 0.07 -0.02 -1.05 -2.82 5.08 -1.99 0.55 114.58 114.39 2e0g h GLU 20 Ca 0.00 0.00 0.29 0.00 -1.00 0.00 0.00 59.36 58.65 2e0g h GLU 20 Cb 0.49 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.63 2e0g h GLU 20 CO 0.00 -0.01 0.64 0.27 -1.00 0.00 0.00 179.01 178.91 2e0g h PHE 21 N -0.02 0.82 -0.51 4.33 -0.00 -1.93 0.70 116.94 120.33 2e0g h PHE 21 Ca 0.36 0.03 0.12 0.00 -0.00 0.00 0.00 57.97 58.48 2e0g h PHE 21 Cb 0.58 -0.23 -0.03 0.00 -0.00 0.00 0.00 35.95 36.27 2e0g h PHE 21 CO -0.64 -0.01 0.35 1.03 -0.00 0.00 0.00 178.31 179.04 2e0g h SER 22 N 0.41 0.14 0.56 -0.68 0.87 -0.18 0.29 113.55 114.97 2e0g h SER 22 Ca 0.66 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.95 2e0g h SER 22 Cb 1.55 -0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 63.44 2e0g h SER 22 CO -0.43 0.08 -1.60 0.24 -0.53 0.00 0.00 176.83 174.59 2e0g h MET 23 N 0.15 0.00 -0.84 2.24 2.86 0.35 -2.48 114.93 117.22 2e0g h MET 23 Ca 0.24 -0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.56 2e0g h MET 23 Cb 0.75 0.00 -0.19 0.00 0.06 0.00 0.00 31.60 32.22 2e0g h MET 23 CO -0.03 0.57 0.40 0.91 1.06 0.00 0.00 176.91 179.82 2e0g n TRP 24 N -3.09 2.69 0.00 -0.22 7.02 -0.33 -4.31 117.44 119.20 2e0g n TRP 24 Ca -0.14 -1.41 0.00 0.00 -1.02 0.00 0.00 57.50 54.93 2e0g n TRP 24 Cb 1.04 -0.78 0.00 0.00 -2.42 0.00 0.00 31.31 29.14 2e0g n TRP 24 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 2e0g n ILE 25 N -0.45 0.00 0.03 -0.99 2.08 0.87 -4.78 119.36 116.11 2e0g n ILE 25 Ca 0.47 0.00 -0.12 0.00 0.56 0.00 0.00 62.75 63.67 2e0g n ILE 25 Cb 1.49 0.00 -0.07 0.00 -0.75 0.00 0.00 39.64 40.31 2e0g n ILE 25 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 2e0g h ARG 26 N 0.00 -0.46 0.00 0.38 3.08 -1.59 -1.10 114.38 114.69 2e0g h ARG 26 Ca 0.00 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2e0g h ARG 26 Cb 0.00 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2e0g h ARG 26 CO 0.00 -0.31 0.00 -1.00 -1.07 0.00 0.00 179.97 177.59 2e0g h PRO 27 N -0.48 0.00 -7.36 0.04 0.13 -1.84 -3.45 132.00 119.05 2e0g h PRO 27 Ca 0.01 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.66 2e0g h PRO 27 Cb 0.52 0.00 0.14 0.00 0.13 0.00 0.00 31.00 31.80 2e0g h PRO 27 CO -0.28 0.00 0.26 -0.51 -0.23 0.00 0.00 178.00 177.24 2e0g s LEU 28 N -4.88 2.23 -0.21 1.56 2.01 -0.42 -4.93 118.68 114.04 2e0g s LEU 28 Ca 0.03 1.38 -0.02 0.00 0.01 0.00 0.00 54.13 55.54 2e0g s LEU 28 Cb 0.09 -3.81 0.06 0.00 0.01 0.00 0.00 46.19 42.55 2e0g s LEU 28 CO 0.42 -2.56 0.02 -1.58 1.01 0.00 0.00 176.35 173.66 2e0g s GLN 29 N -5.00 0.88 0.17 1.70 -0.44 -0.22 -4.94 119.66 111.81 2e0g s GLN 29 Ca 0.63 -0.61 -0.14 0.00 -2.50 0.00 0.00 55.36 52.74 2e0g s GLN 29 Cb -0.17 -2.21 -0.07 0.00 -1.64 0.00 0.00 33.01 28.92 2e0g s GLN 29 CO 0.56 -0.67 0.57 0.00 0.50 0.00 0.00 175.29 176.26 2e0g s ALA 30 N 1.73 3.55 -0.10 1.58 0.00 -1.26 0.02 121.76 127.29 2e0g s ALA 30 Ca -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 51.96 51.83 2e0g s ALA 30 Cb -0.18 -2.54 0.02 0.00 0.00 0.00 0.00 23.12 20.42 2e0g s ALA 30 CO -0.09 0.45 -0.09 -2.00 0.00 0.00 0.00 175.76 174.02 2e0g s GLU 31 N -2.11 1.59 -0.01 0.00 2.12 -0.41 -4.95 118.70 114.93 2e0g s GLU 31 Ca 0.40 -0.31 -0.23 0.00 0.36 0.00 0.00 54.97 55.19 2e0g s GLU 31 Cb -0.14 -1.52 -0.05 0.00 0.26 0.00 0.00 34.13 32.68 2e0g s GLU 31 CO 0.19 -0.16 0.67 -0.51 -0.54 0.00 0.00 175.26 174.91 2e0g s LEU 32 N 1.32 4.39 -0.24 2.70 1.43 -1.26 -1.13 118.68 125.90 2e0g s LEU 32 Ca -0.02 1.24 0.13 0.00 -1.03 0.00 0.00 54.13 54.44 2e0g s LEU 32 Cb -0.14 -3.05 0.51 0.00 0.03 0.00 0.00 46.19 43.54 2e0g s LEU 32 CO -0.04 0.01 1.44 -1.20 0.23 0.00 0.00 176.35 176.79 2e0g n SER 33 N 3.09 3.12 0.00 2.29 7.64 0.56 -4.91 113.62 125.41 2e0g n SER 33 Ca -0.04 -3.40 0.00 0.00 1.01 0.00 0.00 58.87 56.44 2e0g n SER 33 Cb 0.51 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 2e0g n SER 33 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2e0g n ASP 34 N -0.87 0.00 -0.18 6.43 8.00 -1.26 -4.32 116.55 124.34 2e0g n ASP 34 Ca 0.28 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.78 2e0g n ASP 34 Cb 0.97 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 2e0g n ASP 34 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2e0g n ASN 35 N 0.00 0.00 -3.63 -2.24 4.13 -1.26 -5.02 115.26 107.24 2e0g n ASN 35 Ca 0.00 -0.46 -0.02 0.00 1.68 0.00 0.00 54.58 55.77 2e0g n ASN 35 Cb 0.00 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.19 2e0g n ASN 35 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2e0g s THR 36 N 0.00 -0.69 -0.59 3.41 2.01 -1.26 -1.75 115.64 116.76 2e0g s THR 36 Ca 0.00 0.00 -0.13 0.00 0.31 0.00 0.00 61.69 61.87 2e0g s THR 36 Cb 0.00 -1.00 0.15 0.00 0.01 0.00 0.00 72.50 71.66 2e0g s THR 36 CO 0.00 0.00 0.51 -0.22 -0.69 0.00 0.00 174.62 174.22 2e0g s LEU 37 N 2.52 6.13 0.60 4.42 2.96 0.13 -0.32 118.68 135.11 2e0g s LEU 37 Ca -0.07 -2.09 -0.10 0.00 -0.22 0.00 0.00 54.13 51.66 2e0g s LEU 37 Cb -0.10 -2.13 -0.03 0.00 0.50 0.00 0.00 46.19 44.43 2e0g s LEU 37 CO -0.19 -0.72 0.98 0.00 -1.32 0.00 0.00 176.35 175.10 2e0g s ALA 38 N 1.12 3.14 -0.09 5.97 0.00 -0.28 -1.52 121.76 130.09 2e0g s ALA 38 Ca 0.08 -0.25 0.02 0.00 0.00 0.00 0.00 51.96 51.80 2e0g s ALA 38 Cb -0.24 -2.94 0.01 0.00 0.00 0.00 0.00 23.12 19.95 2e0g s ALA 38 CO -0.01 -0.70 -0.13 -0.51 0.00 0.00 0.00 175.76 174.41 2e0g s LEU 39 N -5.11 1.63 -0.30 0.00 2.01 0.17 -1.28 118.68 115.80 2e0g s LEU 39 Ca 0.54 -0.35 -0.08 0.00 0.01 0.00 0.00 54.13 54.25 2e0g s LEU 39 Cb -0.11 -0.93 0.00 0.00 0.01 0.00 0.00 46.19 45.16 2e0g s LEU 39 CO 0.51 0.01 0.10 -0.31 1.01 0.00 0.00 176.35 177.68 2e0g s TYR 40 N 0.89 3.15 0.29 0.29 1.51 0.10 -0.11 117.35 123.48 2e0g s TYR 40 Ca -0.10 -0.83 0.09 0.00 -1.01 0.00 0.00 57.07 55.22 2e0g s TYR 40 Cb -0.15 -2.28 -0.04 0.00 -0.11 0.00 0.00 41.96 39.37 2e0g s TYR 40 CO 0.01 -0.53 0.05 0.00 -1.11 0.00 0.00 175.55 173.96 2e0g s ALA 41 N 1.54 3.28 -0.28 3.71 0.00 0.29 -1.06 121.76 129.25 2e0g s ALA 41 Ca 0.03 -1.72 0.27 0.00 0.00 0.00 0.00 51.96 50.54 2e0g s ALA 41 Cb -0.17 -0.75 1.12 0.00 0.00 0.00 0.00 23.12 23.33 2e0g s ALA 41 CO 0.04 0.18 1.80 -1.00 0.00 0.00 0.00 175.76 176.78 2e0g h PRO 42 N 1.76 0.00 0.00 0.00 0.13 -1.92 0.51 132.00 132.49 2e0g h PRO 42 Ca -0.44 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.60 2e0g h PRO 42 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2e0g h PRO 42 CO 0.62 0.00 0.15 0.27 -0.23 0.00 0.00 178.00 178.81 2e0g n ASN 43 N -2.51 -1.86 0.09 1.44 2.04 -1.26 -4.48 115.26 108.70 2e0g n ASN 43 Ca 0.02 -2.52 -0.04 0.00 -0.44 0.00 0.00 54.58 51.60 2e0g n ASN 43 Cb 0.25 3.17 -0.07 0.00 -2.53 0.00 0.00 39.78 40.60 2e0g n ASN 43 CO 0.00 0.00 0.00 -0.09 -0.44 0.00 0.00 177.26 176.73 2e0g h ARG 44 N 0.00 0.00 -0.24 -3.83 9.65 -1.95 -3.33 114.38 114.69 2e0g h ARG 44 Ca -0.29 0.00 0.05 0.00 -1.10 0.00 0.00 59.98 58.64 2e0g h ARG 44 Cb 1.11 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.64 2e0g h ARG 44 CO 0.37 0.79 -0.11 0.74 2.80 0.00 0.00 179.97 184.56 2e0g h PHE 45 N 0.00 -0.27 -0.90 2.20 -1.00 -1.99 -1.46 116.94 113.51 2e0g h PHE 45 Ca -0.02 0.03 0.04 0.00 2.81 0.00 0.00 57.97 60.82 2e0g h PHE 45 Cb 1.64 0.16 -0.05 0.00 3.61 0.00 0.00 35.95 41.30 2e0g h PHE 45 CO 0.00 -0.18 0.59 0.28 -1.61 0.00 0.00 178.31 177.40 2e0g h VAL 46 N -0.08 1.15 0.35 -0.55 2.07 -1.99 -2.02 116.25 115.18 2e0g h VAL 46 Ca 0.13 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 2e0g h VAL 46 Cb 0.27 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.95 2e0g h VAL 46 CO -0.29 0.21 -0.31 -0.07 0.02 0.00 0.00 177.57 177.12 2e0g h LEU 47 N 1.12 -0.84 -0.41 2.57 3.38 -1.40 0.42 115.31 120.16 2e0g h LEU 47 Ca 0.36 0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.45 2e0g h LEU 47 Cb 0.03 0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 2e0g h LEU 47 CO -0.11 -0.46 0.13 -0.78 0.09 0.00 0.00 178.44 177.31 2e0g h ASP 48 N -0.68 0.12 0.79 -0.43 3.58 -1.14 0.32 116.42 118.98 2e0g h ASP 48 Ca -0.02 0.05 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 2e0g h ASP 48 Cb 0.61 0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.71 2e0g h ASP 48 CO -0.04 0.10 -0.38 -0.25 -2.88 0.00 0.00 179.24 175.80 2e0g h TRP 49 N 0.28 -0.98 -0.51 0.28 2.91 -1.11 -1.64 115.95 115.18 2e0g h TRP 49 Ca 0.19 -0.02 0.10 0.00 1.13 0.00 0.00 58.89 60.29 2e0g h TRP 49 Cb 0.19 0.32 -0.08 0.00 -0.51 0.00 0.00 29.16 29.09 2e0g h TRP 49 CO -0.16 -0.61 0.03 0.28 -1.03 0.00 0.00 178.44 176.95 2e0g h VAL 50 N -1.12 0.63 0.00 2.65 2.07 -0.07 0.43 116.25 120.85 2e0g h VAL 50 Ca -0.11 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2e0g h VAL 50 Cb 0.81 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2e0g h VAL 50 CO 0.18 0.03 0.00 -1.14 0.02 0.00 0.00 177.57 176.66 2e0g n ARG 51 N -5.20 0.11 -0.07 1.57 0.00 0.11 -0.30 116.66 112.89 2e0g n ARG 51 Ca 0.06 0.53 -0.14 0.00 -0.00 0.00 0.00 57.85 58.30 2e0g n ARG 51 Cb 0.27 -1.81 -0.13 0.00 0.00 0.00 0.00 32.46 30.80 2e0g n ARG 51 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 2e0g h ASP 52 N 0.00 0.00 0.00 6.15 1.82 0.87 -3.37 116.42 121.89 2e0g h ASP 52 Ca 0.00 -0.96 0.00 0.00 -0.39 0.00 0.00 57.03 55.68 2e0g h ASP 52 Cb 0.11 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.12 2e0g h ASP 52 CO 0.00 1.01 -0.31 2.29 -1.61 0.00 0.00 179.24 180.63 2e0g n LYS 53 N -4.60 0.16 -0.34 0.28 0.00 -0.99 -4.30 118.16 108.37 2e0g n LYS 53 Ca -0.11 0.06 -0.01 0.00 -0.00 0.00 0.00 58.31 58.26 2e0g n LYS 53 Cb 0.48 -0.76 0.04 0.00 -0.00 0.00 0.00 35.03 34.79 2e0g n LYS 53 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 2e0g n TYR 54 N -3.12 0.04 -0.04 5.58 9.36 0.59 -0.95 117.16 128.62 2e0g n TYR 54 Ca -0.04 1.11 -0.08 0.00 3.32 0.00 0.00 57.90 62.21 2e0g n TYR 54 Cb 0.16 -0.85 -0.05 0.00 -0.63 0.00 0.00 39.34 37.97 2e0g n TYR 54 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 2e0g h LEU 55 N 0.00 -0.94 -1.00 2.98 6.46 -1.55 0.09 115.31 121.35 2e0g h LEU 55 Ca 0.32 0.12 0.22 0.00 -0.12 0.00 0.00 57.88 58.41 2e0g h LEU 55 Cb 0.54 0.38 -0.19 0.00 -0.73 0.00 0.00 40.66 40.66 2e0g h LEU 55 CO -0.89 -0.23 -0.19 -3.20 -0.62 0.00 0.00 178.44 173.30 2e0g n ASN 56 N -4.08 -0.31 0.10 1.25 4.05 -0.13 0.03 115.26 116.19 2e0g n ASN 56 Ca -0.03 1.71 -0.13 0.00 0.45 0.00 0.00 54.58 56.59 2e0g n ASN 56 Cb 0.19 -0.54 -0.07 0.00 1.23 0.00 0.00 39.78 40.59 2e0g n ASN 56 CO 0.00 0.00 0.00 0.78 -3.05 0.00 0.00 177.26 174.99 2e0g h ASN 57 N 0.00 -0.24 0.26 1.20 4.21 -0.73 -1.97 115.58 118.31 2e0g h ASN 57 Ca 0.51 0.02 0.01 0.00 1.21 0.00 0.00 56.30 58.04 2e0g h ASN 57 Cb 0.84 0.08 -0.03 0.00 -1.12 0.00 0.00 38.32 38.10 2e0g h ASN 57 CO -1.01 -0.15 -0.31 0.40 -1.29 0.00 0.00 177.43 175.07 2e0g h ILE 58 N -0.23 0.34 -0.36 2.81 1.08 0.15 -1.78 117.51 119.53 2e0g h ILE 58 Ca -0.01 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.52 2e0g h ILE 58 Cb 0.20 0.34 -0.08 0.00 -3.07 0.00 0.00 36.82 34.21 2e0g h ILE 58 CO -0.00 0.00 -0.48 0.78 -0.69 0.00 0.00 178.15 177.75 2e0g h ASN 59 N -0.62 -1.59 -0.94 1.72 -0.26 -0.67 0.39 115.58 113.61 2e0g h ASN 59 Ca -0.00 0.22 0.18 0.00 -0.56 0.00 0.00 56.30 56.14 2e0g h ASN 59 Cb 0.59 0.67 -0.08 0.00 -1.06 0.00 0.00 38.32 38.43 2e0g h ASN 59 CO -0.09 -0.40 0.60 1.23 -1.06 0.00 0.00 177.43 177.71 2e0g h GLY 60 N -0.39 1.27 0.57 2.83 0.00 -1.20 -1.65 103.07 104.50 2e0g h GLY 60 Ca 0.10 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 2e0g h GLY 60 CO -0.55 0.01 -0.11 -2.00 0.00 0.00 0.00 176.54 173.88 2e0g h LEU 61 N 0.61 0.20 -0.48 3.11 6.46 0.04 -1.89 115.31 123.36 2e0g h LEU 61 Ca 0.50 -0.57 0.10 0.00 -0.12 0.00 0.00 57.88 57.79 2e0g h LEU 61 Cb 0.96 -0.06 -0.09 0.00 -0.73 0.00 0.00 40.66 40.74 2e0g h LEU 61 CO -0.25 0.73 -0.09 -0.07 -0.62 0.00 0.00 178.44 178.14 2e0g h LEU 62 N -0.33 -0.39 -0.23 2.25 4.07 0.53 0.68 115.31 121.89 2e0g h LEU 62 Ca 0.00 0.14 -0.03 0.00 0.08 0.00 0.00 57.88 58.07 2e0g h LEU 62 Cb 0.70 0.27 -0.01 0.00 1.08 0.00 0.00 40.66 42.71 2e0g h LEU 62 CO 0.03 -0.14 0.02 0.74 -1.08 0.00 0.00 178.44 178.01 2e0g h THR 63 N 0.02 1.24 0.00 0.22 2.02 -1.41 -1.23 112.91 113.78 2e0g h THR 63 Ca 0.23 -0.82 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 2e0g h THR 63 Cb 0.36 1.32 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 2e0g h THR 63 CO -0.47 0.26 -0.02 -1.28 0.37 0.00 0.00 175.52 174.38 2e0g h SER 64 N 0.18 0.00 0.08 4.18 0.87 -0.55 0.30 113.55 118.62 2e0g h SER 64 Ca 0.07 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.48 2e0g h SER 64 Cb 0.36 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.32 2e0g h SER 64 CO 0.01 0.02 -0.72 0.15 -0.53 0.00 0.00 176.83 175.76 2e0g h PHE 65 N 0.00 0.31 0.00 2.24 3.04 0.76 -3.45 116.94 119.83 2e0g h PHE 65 Ca -0.00 -0.22 0.00 0.00 3.98 0.00 0.00 57.97 61.72 2e0g h PHE 65 Cb 0.31 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 38.81 2e0g h PHE 65 CO 0.00 1.28 -0.47 0.00 -2.02 0.00 0.00 178.31 177.09 2e0g n GLY 67 N 2.21 -1.77 3.41 0.00 0.00 0.11 -4.59 105.19 104.56 2e0g n GLY 67 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2e0g n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e0g n ALA 68 N 0.18 0.00 0.02 4.61 0.00 -1.26 -4.69 120.51 119.37 2e0g n ALA 68 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 2e0g n ALA 68 Cb 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 19.45 19.18 2e0g n ALA 68 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2e0g n ASP 69 N 0.00 3.60 -4.67 0.00 2.03 -1.26 -5.04 116.55 111.20 2e0g n ASP 69 Ca 0.00 -0.05 -0.30 0.00 0.52 0.00 0.00 54.79 54.96 2e0g n ASP 69 Cb 0.00 1.21 0.16 0.00 -0.72 0.00 0.00 41.12 41.77 2e0g n ASP 69 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2e0g s ALA 70 N -2.27 1.28 1.00 -1.67 0.00 -1.26 -5.01 121.76 113.82 2e0g s ALA 70 Ca -0.02 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.13 2e0g s ALA 70 Cb 0.03 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2e0g s ALA 70 CO 0.20 -2.65 0.00 -0.35 0.00 0.00 0.00 175.76 172.97 2e0g n PRO 71 N -4.12 -0.72 -4.41 0.00 -0.04 -1.26 -5.01 135.00 119.45 2e0g n PRO 71 Ca 0.08 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.33 2e0g n PRO 71 Cb 0.54 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.90 2e0g n PRO 71 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2e0g s GLN 72 N -2.54 1.49 -0.12 0.54 -0.21 -0.72 -4.93 119.66 113.17 2e0g s GLN 72 Ca 0.00 -1.70 -0.05 0.00 0.02 0.00 0.00 55.36 53.63 2e0g s GLN 72 Cb 0.00 -1.29 -0.04 0.00 1.00 0.00 0.00 33.01 32.68 2e0g s GLN 72 CO 0.00 0.17 0.06 -1.17 -2.12 0.00 0.00 175.29 172.23 2e0g s LEU 73 N -3.41 3.90 0.23 2.90 2.96 -1.26 0.18 118.68 124.18 2e0g s LEU 73 Ca 0.27 0.23 0.08 0.00 -0.22 0.00 0.00 54.13 54.48 2e0g s LEU 73 Cb -0.00 -1.94 -0.05 0.00 0.50 0.00 0.00 46.19 44.70 2e0g s LEU 73 CO 0.10 0.33 -0.13 -0.13 -1.32 0.00 0.00 176.35 175.21 2e0g s ARG 74 N -0.56 1.41 0.03 1.98 0.52 -0.58 -4.92 118.95 116.82 2e0g s ARG 74 Ca 0.11 -1.65 -0.04 0.00 -0.52 0.00 0.00 55.73 53.62 2e0g s ARG 74 Cb -0.12 -1.17 -0.01 0.00 0.52 0.00 0.00 34.95 34.17 2e0g s ARG 74 CO 0.02 0.16 0.06 -0.06 0.02 0.00 0.00 175.30 175.50 2e0g s PHE 75 N -2.96 0.20 -0.16 -0.53 0.40 -1.26 0.44 117.98 114.11 2e0g s PHE 75 Ca 0.25 -0.47 -0.34 0.00 -0.60 0.00 0.00 56.93 55.77 2e0g s PHE 75 Cb 0.00 -0.15 0.14 0.00 0.51 0.00 0.00 43.02 43.52 2e0g s PHE 75 CO 0.09 -0.30 1.23 -2.00 0.70 0.00 0.00 175.22 174.93 2e0g s GLU 76 N -2.11 0.32 -0.47 0.44 2.12 0.84 -4.81 118.70 115.03 2e0g s GLU 76 Ca -0.09 -0.13 -0.18 0.00 0.36 0.00 0.00 54.97 54.93 2e0g s GLU 76 Cb -0.04 0.14 0.05 0.00 0.26 0.00 0.00 34.13 34.53 2e0g s GLU 76 CO -0.03 -0.14 0.50 0.08 -0.54 0.00 0.00 175.26 175.14 2e0g s VAL 77 N -2.41 5.04 0.57 3.70 1.01 -1.26 -0.55 120.40 126.50 2e0g s VAL 77 Ca 0.10 -0.58 0.28 0.00 0.00 0.00 0.00 61.98 61.79 2e0g s VAL 77 Cb -0.00 -4.16 0.39 0.00 0.00 0.00 0.00 36.38 32.61 2e0g s VAL 77 CO -0.04 -0.61 1.95 1.23 0.00 0.00 0.00 175.10 177.62 2e0g h GLY 78 N 9.24 0.00 -0.97 4.51 0.00 -0.23 -3.42 103.07 112.20 2e0g h GLY 78 Ca -0.27 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.60 2e0g h GLY 78 CO 0.88 0.00 0.28 -1.59 0.00 0.00 0.00 176.54 176.12 2e0g s THR 79 N -4.72 2.23 0.22 4.70 2.01 -1.24 -5.05 115.64 113.79 2e0g s THR 79 Ca -0.04 -0.18 0.09 0.00 0.31 0.00 0.00 61.69 61.87 2e0g s THR 79 Cb 0.17 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.62 2e0g s THR 79 CO 0.60 -0.01 -0.03 -1.59 -0.69 0.00 0.00 174.62 172.90 2e0g s LYS 80 N -5.34 2.25 1.00 4.92 -2.85 -1.26 -5.02 119.74 113.43 2e0g s LYS 80 Ca 0.61 -1.32 -0.12 0.00 -1.00 0.00 0.00 55.97 54.14 2e0g s LYS 80 Cb -0.11 -2.20 0.19 0.00 -2.06 0.00 0.00 37.83 33.65 2e0g s LYS 80 CO 0.46 0.40 1.09 -1.25 0.10 0.00 0.00 175.35 176.16 2e0g s PRO 81 N -3.29 0.43 0.01 1.78 0.04 -1.26 -5.09 135.00 127.63 2e0g s PRO 81 Ca 0.29 0.53 -0.01 0.00 0.04 0.00 0.00 61.00 61.84 2e0g s PRO 81 Cb -0.08 -1.74 -0.01 0.00 0.04 0.00 0.00 34.50 32.71 2e0g s PRO 81 CO 0.18 -2.73 0.00 0.08 0.04 0.00 0.00 177.00 174.58 2e0g s VAL 82 N -2.96 0.08 0.00 -0.36 1.01 -1.26 -5.16 120.40 111.75 2e0g s VAL 82 Ca 0.65 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.97 2e0g s VAL 82 Cb -0.19 -0.23 0.00 0.00 0.00 0.00 0.00 36.38 35.96 2e0g s VAL 82 CO 0.58 -0.36 0.00 1.07 0.00 0.00 0.00 175.10 176.38 2e0g n THR 83 N 1.93 0.00 -3.23 3.92 5.66 -1.26 -5.17 114.28 116.13 2e0g n THR 83 Ca -0.21 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 60.83 2e0g n THR 83 Cb 0.56 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.30 2e0g n THR 83 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 2e0g s GLN 84 N -1.47 0.02 0.14 1.09 0.74 -1.26 -5.19 119.66 113.74 2e0g s GLN 84 Ca 0.00 0.06 -0.21 0.00 0.05 0.00 0.00 55.36 55.26 2e0g s GLN 84 Cb 0.00 0.03 0.06 0.00 1.10 0.00 0.00 33.01 34.20 2e0g s GLN 84 CO 0.00 -0.01 0.54 0.95 -0.55 0.00 0.00 175.29 176.23 2e0g s THR 85 N 1.90 0.02 0.18 -0.34 -4.23 -1.26 -5.18 115.64 106.74 2e0g s THR 85 Ca -0.00 -0.16 -0.03 0.00 -1.18 0.00 0.00 61.69 60.31 2e0g s THR 85 Cb -0.01 -1.04 0.05 0.00 1.34 0.00 0.00 72.50 72.84 2e0g s THR 85 CO -0.15 -0.09 0.16 -0.81 -0.54 0.00 0.00 174.62 173.19 2e0g n PRO 86 N -0.29 -1.35 -3.25 3.99 -0.04 -1.26 -5.10 135.00 127.71 2e0g n PRO 86 Ca -0.17 -0.26 0.03 0.00 -0.04 0.00 0.00 63.50 63.06 2e0g n PRO 86 Cb 0.64 -0.24 -0.04 0.00 -0.04 0.00 0.00 33.50 33.82 2e0g n PRO 86 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2e0g s GLN 87 N -3.37 0.11 -0.10 0.54 0.74 -1.26 -5.18 119.66 111.14 2e0g s GLN 87 Ca 0.11 0.27 -0.33 0.00 0.05 0.00 0.00 55.36 55.45 2e0g s GLN 87 Cb -0.01 0.16 0.14 0.00 1.10 0.00 0.00 33.01 34.40 2e0g s GLN 87 CO 0.08 -0.04 1.37 0.00 -0.55 0.00 0.00 175.29 176.16 2e0g s ALA 88 N 2.14 -2.37 -0.30 1.58 0.00 -1.26 -5.18 121.76 116.38 2e0g s ALA 88 Ca -0.00 1.03 -0.24 0.00 0.00 0.00 0.00 51.96 52.75 2e0g s ALA 88 Cb -0.02 0.18 0.18 0.00 0.00 0.00 0.00 23.12 23.46 2e0g s ALA 88 CO -0.16 -0.97 1.36 0.00 0.00 0.00 0.00 175.76 175.99 2e0g s ALA 89 N -2.17 -2.26 -0.01 0.00 0.00 -1.26 -5.18 121.76 110.88 2e0g s ALA 89 Ca 0.14 1.75 -0.08 0.00 0.00 0.00 0.00 51.96 53.78 2e0g s ALA 89 Cb 0.05 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.41 2e0g s ALA 89 CO -0.05 -0.15 0.15 0.08 0.00 0.00 0.00 175.76 175.79 2e0g s VAL 90 N 0.21 0.07 -0.10 0.00 1.01 -1.26 -5.17 120.40 115.17 2e0g s VAL 90 Ca 0.05 -0.59 -0.30 0.00 0.00 0.00 0.00 61.98 61.13 2e0g s VAL 90 Cb -0.05 -0.42 0.12 0.00 0.00 0.00 0.00 36.38 36.03 2e0g s VAL 90 CO -0.14 -0.33 0.99 0.28 0.00 0.00 0.00 175.10 175.90 2e0g s THR 91 N -1.20 0.00 -0.29 3.92 -1.32 -1.26 -5.19 115.64 110.30 2e0g s THR 91 Ca -0.13 0.00 -0.31 0.00 -1.21 0.00 0.00 61.69 60.04 2e0g s THR 91 Cb -0.07 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.11 2e0g s THR 91 CO 0.02 0.00 1.37 -0.94 -2.21 0.00 0.00 174.62 172.86 2e0g s SER 92 N -1.92 -0.03 -0.30 8.08 1.04 -1.26 -5.18 113.70 114.14 2e0g s SER 92 Ca 0.03 0.02 -0.23 0.00 0.48 0.00 0.00 55.95 56.25 2e0g s SER 92 Cb -0.01 0.02 0.20 0.00 0.10 0.00 0.00 66.02 66.33 2e0g s SER 92 CO -0.05 -0.03 1.43 0.20 0.98 0.00 0.00 173.24 175.78 2e0g s ASN 93 N -1.27 -0.03 -0.03 7.02 -0.87 -1.26 -5.17 114.94 113.33 2e0g s ASN 93 Ca 0.10 0.06 0.01 0.00 -1.57 0.00 0.00 52.86 51.45 2e0g s ASN 93 Cb -0.01 0.25 0.03 0.00 -0.02 0.00 0.00 41.25 41.50 2e0g s ASN 93 CO -0.07 -0.01 -0.01 -0.69 -2.57 0.00 0.00 177.10 173.76 2e0g s VAL 94 N 0.22 0.22 -0.30 1.60 1.01 -1.26 -5.13 120.40 116.76 2e0g s VAL 94 Ca 0.05 0.05 -0.22 0.00 0.00 0.00 0.00 61.98 61.86 2e0g s VAL 94 Cb -0.04 -0.30 0.19 0.00 0.00 0.00 0.00 36.38 36.23 2e0g s VAL 94 CO -0.15 0.15 1.36 0.00 0.00 0.00 0.00 175.10 176.46 2e0g s ALA 95 N 0.96 -2.35 -0.32 5.51 0.00 -1.26 -5.12 121.76 119.18 2e0g s ALA 95 Ca -0.10 1.79 -0.05 0.00 0.00 0.00 0.00 51.96 53.60 2e0g s ALA 95 Cb -0.13 -1.83 0.25 0.00 0.00 0.00 0.00 23.12 21.41 2e0g s ALA 95 CO -0.01 -0.17 1.22 0.00 0.00 0.00 0.00 175.76 176.79 2e0g n ALA 96 N 2.11 -3.85 -1.02 0.00 0.00 -1.26 -5.17 120.51 111.31 2e0g n ALA 96 Ca -0.13 -0.06 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 2e0g n ALA 96 Cb 0.57 -3.43 0.08 0.00 0.00 0.00 0.00 19.45 16.67 2e0g n ALA 96 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2e0g n PRO 97 N 1.91 -1.74 -3.58 0.00 -0.04 -1.26 -5.10 135.00 125.20 2e0g n PRO 97 Ca 0.05 -0.59 0.03 0.00 -0.04 0.00 0.00 63.50 62.95 2e0g n PRO 97 Cb 0.69 -0.55 -0.00 0.00 -0.04 0.00 0.00 33.50 33.60 2e0g n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2e0g s ALA 98 N -2.99 -2.41 -0.20 0.55 0.00 -1.26 -5.19 121.76 110.26 2e0g s ALA 98 Ca 0.24 0.88 -0.31 0.00 0.00 0.00 0.00 51.96 52.77 2e0g s ALA 98 Cb -0.02 0.27 0.15 0.00 0.00 0.00 0.00 23.12 23.51 2e0g s ALA 98 CO 0.18 -1.05 1.18 -1.14 0.00 0.00 0.00 175.76 174.93 2e0g s GLN 99 N -2.17 0.34 -0.01 0.00 -0.44 -1.26 -5.18 119.66 110.93 2e0g s GLN 99 Ca 0.15 -0.00 -0.05 0.00 -2.50 0.00 0.00 55.36 52.95 2e0g s GLN 99 Cb 0.07 0.16 0.00 0.00 -1.64 0.00 0.00 33.01 31.60 2e0g s GLN 99 CO -0.06 -0.12 0.11 0.08 0.50 0.00 0.00 175.29 175.80 2e0g s VAL 100 N -1.58 0.06 -0.30 1.34 1.01 -1.26 -5.16 120.40 114.52 2e0g s VAL 100 Ca 0.06 -0.53 -0.23 0.00 0.00 0.00 0.00 61.98 61.27 2e0g s VAL 100 Cb -0.01 -0.34 0.19 0.00 0.00 0.00 0.00 36.38 36.22 2e0g s VAL 100 CO -0.04 -0.29 1.39 0.00 0.00 0.00 0.00 175.10 176.16 2e0g s ALA 101 N -0.99 -2.29 0.05 5.51 0.00 -1.26 -5.19 121.76 117.59 2e0g s ALA 101 Ca -0.11 1.74 -0.09 0.00 0.00 0.00 0.00 51.96 53.50 2e0g s ALA 101 Cb -0.06 -1.80 0.03 0.00 0.00 0.00 0.00 23.12 21.29 2e0g s ALA 101 CO 0.01 -0.14 0.43 0.00 0.00 0.00 0.00 175.76 176.06 2e0g n GLN 102 N 1.88 0.20 -3.61 0.00 10.64 -1.26 -5.19 117.38 120.04 2e0g n GLN 102 Ca -0.12 -0.50 -0.03 0.00 -1.83 0.00 0.00 57.00 54.53 2e0g n GLN 102 Cb 0.57 0.71 -0.01 0.00 -0.86 0.00 0.00 30.24 30.64 2e0g n GLN 102 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.06 175.15 2e0g s THR 103 N -2.30 0.00 -0.50 -0.39 -1.32 -1.26 -5.11 115.64 104.76 2e0g s THR 103 Ca 0.10 -0.14 0.06 0.00 -1.21 0.00 0.00 61.69 60.50 2e0g s THR 103 Cb -0.01 -1.45 0.22 0.00 -1.51 0.00 0.00 72.50 69.75 2e0g s THR 103 CO 0.01 0.00 0.82 1.67 -2.21 0.00 0.00 174.62 174.91 2e0g n GLN 104 N -0.29 0.69 -1.75 7.08 -0.06 -1.26 -5.15 117.38 116.65 2e0g n GLN 104 Ca -0.04 -1.90 -0.33 0.00 -2.00 0.00 0.00 57.00 52.73 2e0g n GLN 104 Cb 0.60 -1.47 0.05 0.00 -4.06 0.00 0.00 30.24 25.37 2e0g n GLN 104 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 2e0g s PRO 105 N 0.69 2.79 -0.02 3.69 0.04 -1.26 -5.07 135.00 135.87 2e0g s PRO 105 Ca 0.31 1.38 0.01 0.00 0.04 0.00 0.00 61.00 62.75 2e0g s PRO 105 Cb 0.15 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.75 2e0g s PRO 105 CO -0.18 -1.26 -0.03 -0.65 0.04 0.00 0.00 177.00 174.92 2e0g s GLN 106 N -4.11 0.40 0.00 4.56 -0.21 -1.26 -5.37 119.66 113.67 2e0g s GLN 106 Ca 0.67 -0.08 0.00 0.00 0.02 0.00 0.00 55.36 55.97 2e0g s GLN 106 Cb -0.20 -0.45 0.00 0.00 1.00 0.00 0.00 33.01 33.36 2e0g s GLN 106 CO 0.42 0.00 0.00 -2.13 -2.12 0.00 0.00 175.29 171.46